Crystallography Open Database

Information card for entry 7703954

Preview

Coordinates	7703954.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36.73 H43.09 Cl0.64 Co2 I1.36 N6.36 O8
Calculated formula	C36.728 H43.092 Cl0.637 Co2 I1.362 N6.364 O8
Title of publication	Coligand modulated oxidative O-demethylation of a methyl ether appended tetradentate N-ligand in Co(ii) complexes.
Authors of publication	Anjana, S. S.; Varghese, B.; Murthy, Narasimha N.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	10
Pages of publication	3187 - 3197
a	16.073 ± 0.0004 Å
b	16.52 ± 0.0004 Å
c	16.853 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	4474.91 ± 0.19 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0777
Residual factor for significantly intense reflections	0.0596
Weighted residual factors for significantly intense reflections	0.1827
Weighted residual factors for all reflections included in the refinement	0.1988
Goodness-of-fit parameter for all reflections included in the refinement	1.08
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
250132 (current)	2020-04-04	cif/ Adding structures of 7703952, 7703953, 7703954, 7703955, 7703956, 7703957, 7703958 via cif-deposit CGI script.	7703954.cif